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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 214 families. | |||||
1 | 2Z81 | - | PCJ | C54 H105 N O6 S | CCCCCCCCCC.... |
2 | 3A7C | - | PDK | C47 H87 N4 O17 P | CCCCCCCCCC.... |
3 | 6NIG | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 181 families. | |||||
1 | 2Z81 | - | PCJ | C54 H105 N O6 S | CCCCCCCCCC.... |
2 | 3A7C | - | PDK | C47 H87 N4 O17 P | CCCCCCCCCC.... |
3 | 6NIG | - | NAG | C8 H15 N O6 | CC(=O)N[C@.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | PDK | 1 | 1 |
2 | PEV | 0.577778 | 0.833333 |
3 | PTY | 0.577778 | 0.833333 |
4 | 3PE | 0.577778 | 0.833333 |
5 | PEF | 0.577778 | 0.833333 |
6 | PEH | 0.577778 | 0.833333 |
7 | 8PE | 0.577778 | 0.833333 |
8 | 9PE | 0.571429 | 0.833333 |
9 | PEE | 0.571429 | 0.819672 |
10 | 6PL | 0.55914 | 0.777778 |
11 | PLD | 0.55914 | 0.777778 |
12 | HGX | 0.55914 | 0.777778 |
13 | LIO | 0.55914 | 0.777778 |
14 | PC7 | 0.55914 | 0.777778 |
15 | PX4 | 0.55914 | 0.777778 |
16 | HGP | 0.55914 | 0.777778 |
17 | CD4 | 0.549451 | 0.711864 |
18 | P5S | 0.542553 | 0.786885 |
19 | LHG | 0.537634 | 0.716667 |
20 | PGT | 0.537634 | 0.716667 |
21 | 8SP | 0.531915 | 0.786885 |
22 | L9Q | 0.525253 | 0.819672 |
23 | 6OU | 0.525253 | 0.819672 |
24 | LOP | 0.525253 | 0.819672 |
25 | XP5 | 0.521277 | 0.777778 |
26 | RXY | 0.52 | 0.819672 |
27 | PX2 | 0.516854 | 0.666667 |
28 | PX8 | 0.516854 | 0.666667 |
29 | PCW | 0.509804 | 0.765625 |
30 | 3PH | 0.505618 | 0.683333 |
31 | LPP | 0.505618 | 0.683333 |
32 | 7PH | 0.505618 | 0.683333 |
33 | 6PH | 0.505618 | 0.683333 |
34 | F57 | 0.505618 | 0.683333 |
35 | PA8 | 0.505618 | 0.666667 |
36 | PIF | 0.50505 | 0.61194 |
37 | CN3 | 0.50505 | 0.711864 |
38 | PII | 0.5 | 0.621212 |
39 | PCK | 0.5 | 0.742424 |
40 | 7P9 | 0.5 | 0.683333 |
41 | ZPE | 0.5 | 0.819672 |
42 | P6L | 0.495146 | 0.704918 |
43 | OZ2 | 0.490385 | 0.704918 |
44 | D3D | 0.490196 | 0.704918 |
45 | PGW | 0.490196 | 0.704918 |
46 | GP7 | 0.485981 | 0.819672 |
47 | PGV | 0.485437 | 0.704918 |
48 | PIZ | 0.485437 | 0.621212 |
49 | DR9 | 0.485437 | 0.704918 |
50 | CN6 | 0.484848 | 0.711864 |
51 | HXG | 0.484211 | 0.777778 |
52 | PEK | 0.481132 | 0.819672 |
53 | DGG | 0.481132 | 0.68254 |
54 | PGK | 0.480769 | 0.68254 |
55 | PSC | 0.477064 | 0.765625 |
56 | P50 | 0.47619 | 0.786885 |
57 | PIO | 0.475728 | 0.61194 |
58 | 52N | 0.475728 | 0.61194 |
59 | IP9 | 0.475728 | 0.621212 |
60 | PSF | 0.46875 | 0.786885 |
61 | PD7 | 0.466667 | 0.683333 |
62 | 44G | 0.463158 | 0.716667 |
63 | D21 | 0.459184 | 0.672131 |
64 | M7U | 0.459184 | 0.683333 |
65 | B7N | 0.457944 | 0.61194 |
66 | CDL | 0.44898 | 0.65 |
67 | PCF | 0.431373 | 0.714286 |
68 | PC1 | 0.431373 | 0.714286 |
69 | MC3 | 0.431373 | 0.714286 |
70 | PG8 | 0.43 | 0.688525 |
71 | 44E | 0.428571 | 0.683333 |
72 | EPH | 0.418803 | 0.819672 |
73 | T7X | 0.417391 | 0.61194 |
74 | 8ND | 0.410526 | 0.633333 |
75 | AGA | 0.407767 | 0.688525 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 2z81.bio1) has 30 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |